TL;DR: 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine (CAS 161058-77-1) is a chemical compound with molecular formula C9H11N5O and molecular weight 205.09636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-methylprop-2-enoxy)-7H-purin-2-amine
Also Known As: O6-Substituted Guanine Deriv. 16, 6-(2-Methylallyloxy)-9H-purine-2-amine, 6-(2-methylprop-2-enoxy)-7H-purin-2-amine, J1.446.703C, 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine
| Molecular Formula | C9H11N5O |
| Molecular Weight | 205.09636 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 89.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.09636 Da |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
| SMILES | CC(=C)COC1=NC(=NC2=C1NC=N2)N |
| InChIKey | SKVCEFNZQMPWEN-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine. Following Lipinski's Rule of Five, 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine is 161058-77-1.
The molecular formula of 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine is C9H11N5O.
The molecular weight of 6-[(2-methylprop-2-en-1-yl)oxy]-9H-purin-2-amine is 205.09636 g/mol.
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